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© September 2007; August 2010 Lorentz JÄNTSCHI && Sorana Daniela BOLBOACĂ

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forcefield mm+
sys 0 0 1
view 40 0.1264 63.85 23.85 -0.07146408 0.1279821 -0.9891984 -0.01857308 0.9913914 0.1296076 0.9972702 0.02763475 -0.06847185 -1.9669 -0.20059 -62.421
seed 0
mol 1
atom 1 - C ** - -0.08997917 -1.0815 -3.834 5.8223 3 2 d 6 s 7 s
atom 2 - C ** - -0.262002 -1.0426 -2.368 5.5008 3 1 d 3 s 16 s
atom 3 - C ** - 0.1781464 0.3776 -1.1431 5.6399 4 2 s 4 s 18 s 19 s
atom 4 - C ** - -0.1141357 1.3605 -2.6813 4.3095 3 3 s 5 s 8 s
atom 5 - C ** - -0.09336472 1.7452 -4.4858 4.5899 2 4 s 6 s
atom 6 - C ** - 0.2948771 0.3411 -4.8946 5.4896 3 1 s 5 s 29 d
atom 7 - C ** - -0.001246452 -2.727999 -4.2396 6.4735 1 1 s
atom 8 - C ** - 0.1792581 2.5629 -1.9915 3.4655 3 4 s 9 s 41 s
atom 9 - C ** - -0.1359558 1.3235 -0.7451 2.9962 3 8 s 10 s 14 s
atom 10 - C ** - -0.09921932 1.8347 0.7188 2.7275 3 9 s 11 s 23 d
atom 11 - C ** - 0.1853261 0.7275 1.8779 1.9142 3 10 s 12 s 30 s
atom 12 - C ** - -0.07699537 -1.2052 1.4439 1.6411 2 11 s 13 s
atom 13 - C ** - 0.1078048 -1.4787 -0.3688 1.4033 3 12 s 14 s 45 s
atom 14 - C ** - 0.1100688 -0.3712 -1.3973 2.2614 4 9 s 13 s 15 s 24 s
atom 15 - C ** - -0.03933048 -1.7436 -0.7758 4.0091 3 14 s 16 s 25 s
atom 16 - C ** - 0.1549852 -2.4077 -1.8534 4.9338 3 2 s 15 s 17 s
atom 17 - O ** - -0.3524666 -3.3853 -2.8813 4.066099 2 16 s 20 s
atom 18 - C ** - -0.08371401 0.17 -0.2635 7.5495 1 3 s
atom 19 - C ** - -0.1587186 0.3263 0.97 5.0797 1 3 s
atom 20 - C ** - 0.3621035 -5.0429 -2.9504 3.9785 3 17 s 21 s 22 d
atom 21 - C ** - -0.02957439 -6.0368 -3.6157 2.755 1 20 s
atom 22 - O ** - -0.3388448 -5.6532 -2.5805 4.9825 1 20 d
atom 23 - C ** - -0.1866837 3.1475 0.9973 3.4017 1 10 d
atom 24 - C ** - -0.03239441 0.3683 -3.1917 1.1938 1 14 s
atom 25 - O ** - -0.3698163 -2.738 0.4656 3.7583 2 15 s 26 s
atom 26 - C ** - 0.3515856 -2.990199 1.6569 4.9325 3 25 s 27 s 28 d
atom 27 - C ** - -0.09521532 -2.5121 3.2069 4.6757 1 26 s
atom 28 - O ** - -0.3116307 -3.5148 1.4077 6.0405 1 26 d
atom 29 - O ** - -0.3210111 0.3127 -6.0843 5.7991 1 6 d
atom 30 - O ** - -0.3087754 1.3111 2.0974 0.6057 2 11 s 31 s
atom 31 - C ** - 0.4145339 0.8972 3.1085 -0.3725 3 30 s 32 s 40 d
atom 32 - C ** - -0.1876612 0.4411 2.8857 -1.8277 2 31 s 33 d
atom 33 - C ** - 0.003512859 -0.2074 3.9918 -2.3798 2 32 d 34 s
atom 34 - C ** - -0.05861568 -0.0619 4.4855 -3.8448 3 33 s 35 d 39 s
atom 35 - C ** - -0.07224083 -0.6516 5.6072 -4.2833 2 34 d 36 s
atom 36 - C ** - -0.1045556 -0.5978 5.8374 -5.6624 2 35 s 37 d
atom 37 - C ** - -0.09119987 0.0748 4.9808 -6.593199 2 36 d 38 s
atom 38 - C ** - -0.1100292 0.7842 3.8677 -6.1496 2 37 s 39 d
atom 39 - C ** - -0.08521652 0.7653 3.6196 -4.77 2 34 s 38 d
atom 40 - O ** - -0.3496137 1.0777 4.2797 -0.0719 1 31 d
atom 41 - O ** - -0.396781 3.2935 -2.9341 2.2181 2 8 s 42 s
atom 42 - C ** - 0.3498969 4.5745 -2.6515 1.1304 3 41 s 43 s 44 d
atom 43 - C ** - -0.01471424 5.5285 -3.6732 0.1283 1 42 s
atom 44 - O ** - -0.3163328 4.821 -1.468799 0.9242 1 42 d
atom 45 - O ** - -0.3949814 -1.8153 -0.8438 -0.1554 2 13 s 46 s
atom 46 - C ** - 0.3897591 -1.6274 -2.2649 -0.9544 3 45 s 47 s 48 d
atom 47 - C ** - -0.09965277 -0.4866 -2.4434 -2.1115 1 46 s
atom 48 - O ** - -0.3215413 -2.2822 -3.2789 -0.6836 1 46 d
endmol 1